(2S)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-N'-oxidanyl-N-phenyl-octanediamide

Systemtic Name: (2S)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-N'-oxidanyl-N-phenyl-octanediamide Openeye Name: (2S)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-8-(hydroxyamino)-8-oxo-N-phenyl-octanamide CAS Name: (2S)-2-[[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]amino]-N'-hydroxy-N-phenyloctanediamide IUPAC Name: (2S)-2-[2-(3,4-dimethoxyphenyl)ethylcarbamoylamino]-N'-hydroxy-N-phenyloctanediamide Traditional Name: (2S)-2-(homoveratrylcarbamoylamino)-8-(hydroxyamino)-8-keto-N-phenyl-caprylamide Formula: C25H34N4O6 MolecularWeight: 486.56066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)NC(CCCCCC(=O)NO)C(=O)NC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)N[C@@H](CCCCCC(=O)NO)C(=O)NC2=CC=CC=C2)OC

InChI

InChI=1S/C25H34N4O6/c1-34-21-14-13-18(17-22(21)35-2)15-16-26-25(32)28-20(11-7-4-8-12-23(30)29-33)24(31)27-19-9-5-3-6-10-19/h3,5-6,9-10,13-14,17,20,33H,4,7-8,11-12,15-16H2,1-2H3,(H,27,31)(H,29,30)(H2,26,28,32)/t20-/m0/s1